N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-6-phenyl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-6-phenyl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-6-phenyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-6-phenyl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-6-phenylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-(6-phenylthieno[2,3-d]pyrimidin-4-yl)amine Formula: C20H14BrN3O2S MolecularWeight: 440.31306

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)NC3=C4C=C(SC4=NC=N3)C5=CC=CC=C5

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)NC3=C4C=C(SC4=NC=N3)C5=CC=CC=C5

InChI

InChI=1S/C20H14BrN3O2S/c21-14-9-16-17(26-7-6-25-16)10-15(14)24-19-13-8-18(12-4-2-1-3-5-12)27-20(13)23-11-22-19/h1-5,8-11H,6-7H2,(H,22,23,24)